Difference between revisions of "HOMO-I-CIT"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HOMO-I-CIT HOMO-I-CIT] == * smiles: ** C(CC(=O)[O-])C(C(=O)[O-])C(O)C(=O)[O-] * common name: **...") |
|||
| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C(CC(=O)[O-])C(C(=O)[O-])C(O)C(=O)[O-] | ** C(CC(=O)[O-])C(C(=O)[O-])C(O)C(=O)[O-] | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 203.128 | ** 203.128 | ||
| + | * inchi key: | ||
| + | ** InChIKey=OEJZZCGRGVFWHK-WVZVXSGGSA-K | ||
| + | * common name: | ||
| + | ** (1R,2S)-homoisocitrate | ||
* Synonym(s): | * Synonym(s): | ||
** (-)-threo-isohomocitrate | ** (-)-threo-isohomocitrate | ||
| Line 27: | Line 27: | ||
* [[RXN-13722]] | * [[RXN-13722]] | ||
== External links == | == External links == | ||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.4573580.html 4573580] | ** [http://www.chemspider.com/Chemical-Structure.4573580.html 4573580] | ||
| Line 35: | Line 33: | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C05662 C05662] | ** [http://www.genome.jp/dbget-bin/www_bget?C05662 C05662] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5459812 5459812] | ||
{{#set: smiles=C(CC(=O)[O-])C(C(=O)[O-])C(O)C(=O)[O-]}} | {{#set: smiles=C(CC(=O)[O-])C(C(=O)[O-])C(O)C(=O)[O-]}} | ||
| − | |||
| − | |||
{{#set: molecular weight=203.128 }} | {{#set: molecular weight=203.128 }} | ||
| + | {{#set: inchi key=InChIKey=OEJZZCGRGVFWHK-WVZVXSGGSA-K}} | ||
| + | {{#set: common name=(1R,2S)-homoisocitrate}} | ||
{{#set: common name=(-)-threo-isohomocitrate|(-)-1-hydroxy-1,2,4-butanetricarboxylate|homo-I-cit|1-hydroxy-1,2,4-butanetricarboxylate|2-hydroxy-3-carboxyadipate|homo-iso-citrate|1-(R)-hydroxy-2-(S)-1,2,4-butanetricarboxylic acid|1-hydroxybutane-1,2,4-tricarboxylate|(1R,2S)-1-hydroxybutane-1,2,4-tricarboxylate|homoisocitrate}} | {{#set: common name=(-)-threo-isohomocitrate|(-)-1-hydroxy-1,2,4-butanetricarboxylate|homo-I-cit|1-hydroxy-1,2,4-butanetricarboxylate|2-hydroxy-3-carboxyadipate|homo-iso-citrate|1-(R)-hydroxy-2-(S)-1,2,4-butanetricarboxylic acid|1-hydroxybutane-1,2,4-tricarboxylate|(1R,2S)-1-hydroxybutane-1,2,4-tricarboxylate|homoisocitrate}} | ||
{{#set: reversible reaction associated=HOMOACONITATE-HYDRATASE-RXN|RXN-13722}} | {{#set: reversible reaction associated=HOMOACONITATE-HYDRATASE-RXN|RXN-13722}} | ||
Latest revision as of 14:54, 10 January 2019
Contents
Metabolite HOMO-I-CIT
- smiles:
- C(CC(=O)[O-])C(C(=O)[O-])C(O)C(=O)[O-]
- molecular weight:
- 203.128
- inchi key:
- InChIKey=OEJZZCGRGVFWHK-WVZVXSGGSA-K
- common name:
- (1R,2S)-homoisocitrate
- Synonym(s):
- (-)-threo-isohomocitrate
- (-)-1-hydroxy-1,2,4-butanetricarboxylate
- homo-I-cit
- 1-hydroxy-1,2,4-butanetricarboxylate
- 2-hydroxy-3-carboxyadipate
- homo-iso-citrate
- 1-(R)-hydroxy-2-(S)-1,2,4-butanetricarboxylic acid
- 1-hydroxybutane-1,2,4-tricarboxylate
- (1R,2S)-1-hydroxybutane-1,2,4-tricarboxylate
- homoisocitrate
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
"C(CC(=O)[O-])C(C(=O)[O-])C(O)C(=O)[O-" cannot be used as a page name in this wiki.
